[gmx-users] energygrps long-range interaction

gyorgy.hantal at fc.up.pt gyorgy.hantal at fc.up.pt
Fri Jul 1 19:01:15 CEST 2011


Dear Users,

I'm wondering if it is possible to extract the long-range part of the  
interactions of energy-groups. In the output I see only short-range  
terms.

I am interested in the total interaction energy of an energy group. I  
would guess that one should be able to get the long-range part of the  
interactions somehow... Or am I wrong?

Thanks in advance.

Gyorgy




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